* LIGAND DATABASE FILE (OPLS2005)
*
001      57    58    100    159     294
    1     0 S   NP   _N1_     1    28.63352    94.33246   -21.76581
    2     1 S   H    _HN1     2     1.02959    88.36217    27.96832
    3     1 S   H    _H1_     3     1.02832    27.73244   160.94046
    4     1 S   H    _H2_     4     1.02773    95.54112   -80.34415
    5     1 S   CT   _CA1     5     1.50168   137.88951   147.10923
    6     5 S   HC   _HA1     6     1.09572   105.16457    65.91817
    7     5 S   CO3  _C1_     7     1.53823   112.51321   -54.12277
    8     7 S   O2Z  _O11     8     1.26364   114.98514   -37.75576
    9     7 S   O2Z  _O12     9     1.26249   114.98404   141.39287
   10     5 S   CT   _CB1    10     1.53123   107.39489  -176.13203
   11    10 S   HC   HB11    11     1.09815   109.26324   -49.19558
   12    10 S   HC   HB12    12     1.09808   110.42589    67.33200
   13    10 S   CT   _CG1    13     1.52981   112.73254  -170.30308
   14    13 S   HC   HG11    14     1.09448   110.58467   -63.18659
   15    13 S   HC   HG12    15     1.09668   109.95579    55.64972
   16    13 S   C    _CD1    16     1.51857   112.40124   175.31851
   17    16 S   O    _OE1    17     1.22721   123.19379   -13.10357
   18    16 S   N    _N2_    18     1.38606   111.69995   168.84654
   19    18 S   H    _HN2    19     1.01592   118.92755    -2.11729
   20    18 S   CT1  _CA2    20     1.46095   123.42919   173.99123
   21    20 S   HC   _HA2    21     1.09750   109.40460   -11.28479
   22    20 S   C    _C2_    22     1.53622   107.64995  -126.32835
   23    22 S   O    _O2_    23     1.23008   122.35897  -143.87880
   24    20 S   CT   _CB2    32     1.53398   112.17927   111.38662
   25    24 S   HC   HB21    33     1.09522   110.08745    50.84812
   26    24 S   HC   HB22    34     1.09319   109.16999   169.53578
   27    22 S   N    _N3_    24     1.38538   113.32335    43.29963
   28    27 S   H    _HN3    25     1.01520   118.95629    -0.48335
   29    24 S   S    _SG2    35     1.83173   111.93662   -70.64555
   30    27 S   CT   _CA3    26     1.45462   123.50611   175.13490
   31    30 S   HC   HA31    27     1.09521   109.30978    22.88864
   32    30 S   HC   HA32    28     1.09500   107.09792   139.92393
   33    29 S   CT   _C15    36     1.86282   100.96184  -171.51300
   34    33 S   Cl   Cl3_    37     1.82529   110.40580   178.19832
   35    30 S   CO3  _C3_    29     1.52934   113.08476  -100.62743
   36    35 S   O2Z  _O31    30     1.26410   115.41225   -43.66964
   37    35 S   O2Z  _O32    31     1.26355   114.97069   137.23978
   38    33 S   CM   _C10    38     1.56886   110.69824   -62.85392
   39    38 S   CM   _C7_    39     1.37076   126.83763   -58.97667
   40    38 S   CM   _C11    50     1.47942   113.53894   117.02093
   41    40 S   HC   _H4_    51     1.08472   118.26754  -170.87581
   42    39 S   CO4  _C6_    40     1.51582   121.67327     9.93981
   43    42 S   O    _O33    41     1.22132   125.06277   -53.13182
   44    40 S   CM   _C12    52     1.34004   125.17971     5.85012
   45    44 S   Cl   Cl5_    53     1.72901   120.34297  -179.18123
   46    42 S   CM   _C5_    42     1.49137   113.20730   128.59790
   47    46 S   Cl   Cl6_    43     1.71245   118.11173  -154.87120
   48    44 S   CM   _C13    54     1.43267   122.15619    -0.79204
   49    48 S   HC   _H5_    55     1.08597   118.56270   178.24175
   50    46 S   CM   _C4_    44     1.33966   118.97546    26.80264
   51    50 S   HC   _H3_    45     1.08622   120.74161   179.47288
   52    33 S   CM   _C14    56     1.53399   108.48891    64.56138
   53    52 S   Cl   Cl4_    57     1.74381   118.79403    58.52365
   54    50 S   CM   _C9_    46     1.45074   120.63256     5.02157
   55    54 S   Cl   Cl1_    47     1.73139   115.99647   157.96846
   56    39 S   CM   _C8_    48     1.47763   126.61835  -177.82687
   57    56 S   Cl   Cl2_    49     1.74154   118.62735    51.24692
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   8   5   4   3
  12   6   2   1   1  14  13   8   3   8   4   5   3   6   3   3
   2   5   3   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    52    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    48    52    53  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    56    40    41    44    48    49    52    53  
   38    39    40    48    52    53  
   36    37  
   37  
    0  
   39    42    43    46    54    56    57    40    41    44    45    48    52    53  
   42    43    46    47    50    54    55    56    57    40    41    44    52  
   41    44    45    48    49    52    42    56  
   44    45    48  
   43    46    47    50    51    54    56    57  
   46    47    50    56  
   45    48    49    52    53  
   48    49    52  
   47    50    51    54    55    56  
   50    51    54  
   49    52    53  
   52    53  
   51    54    55    56    57  
   54    55    56  
   53  
    0  
   55    56    57  
   56    57  
   57  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.207500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   45   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   46   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   47   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   54   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   56   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   57   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   245.000  1.781
   33    38   317.000  1.510
   33    52   317.000  1.510
   38    39   549.000  1.340
   38    40   380.000  1.444
   39    42   320.000  1.462
   39    56   380.000  1.444
   42    43   570.000  1.229
   42    46   320.000  1.462
   46    47   300.000  1.725
   46    50   549.000  1.340
   50    51   340.000  1.080
   50    54   380.000  1.444
   54    55   300.000  1.725
   54    56   549.000  1.340
   56    57   300.000  1.725
   40    41   340.000  1.080
   40    44   549.000  1.340
   44    45   300.000  1.725
   44    48   380.000  1.444
   48    49   340.000  1.080
   48    52   549.000  1.340
   52    53   300.000  1.725
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    85.00000  110.65400
   29    33    38    75.00000  112.20000
   29    33    52    75.00000  112.20000
   33    38    39    70.00000  124.00000
   33    38    40    70.00000  124.00000
   33    52    48    70.00000  124.00000
   33    52    53    75.00000  111.02000
   38    33    34    75.00000  111.90500
   38    39    42    65.00000  118.96000
   38    39    56    70.00000  123.01800
   38    40    41    35.00000  120.00000
   38    40    44    70.00000  123.01800
   39    42    43    80.00000  123.72100
   39    42    46    65.00000  118.65900
   39    56    54    70.00000  123.01800
   39    56    57    75.00000  121.50000
   42    46    47    70.00000  120.00000
   42    46    50    65.00000  118.96000
   46    42    43    80.00000  123.72100
   46    50    51    35.00000  120.00000
   46    50    54    70.00000  123.01800
   50    46    47    75.00000  121.50000
   50    54    55    75.00000  121.50000
   50    54    56    70.00000  123.01800
   54    50    51    35.00000  120.00000
   54    56    57    75.00000  121.50000
   56    39    42    65.00000  118.96000
   56    54    55    75.00000  121.50000
   40    38    39    70.00000  123.01800
   40    44    45    75.00000  121.50000
   40    44    48    70.00000  123.01800
   44    40    41    35.00000  120.00000
   44    48    49    35.00000  120.00000
   44    48    52    70.00000  123.01800
   48    44    45    75.00000  121.50000
   48    52    53    75.00000  121.50000
   52    33    34    75.00000  111.90500
   52    33    38    70.00000  110.12100
   52    48    49    35.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    52  -0.62250  1.0 1.0
   24    29    33    52  -0.38450 -1.0 2.0
   24    29    33    52   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    52    48   0.42700  1.0 1.0
   29    33    52    48  -0.70350 -1.0 2.0
   29    33    52    48  -0.43150  1.0 3.0
   29    33    52    53   0.09700  1.0 1.0
   29    33    52    53   0.15600 -1.0 2.0
   29    33    52    53  -0.50800  1.0 3.0
   33    38    39    42   7.00000 -1.0 2.0
   33    38    39    56   7.00000 -1.0 2.0
   33    38    40    41   0.00000  1.0 1.0
   33    38    40    44  -0.18600  1.0 3.0
   34    33    38    39   0.09700  1.0 1.0
   34    33    38    39   0.15600 -1.0 2.0
   34    33    38    39  -0.50800  1.0 3.0
   34    33    38    40   0.09700  1.0 1.0
   34    33    38    40   0.15600 -1.0 2.0
   34    33    38    40  -0.50800  1.0 3.0
   34    33    52    48   0.09700  1.0 1.0
   34    33    52    48   0.15600 -1.0 2.0
   34    33    52    48  -0.50800  1.0 3.0
   34    33    52    53   0.09700  1.0 1.0
   34    33    52    53   0.15600 -1.0 2.0
   34    33    52    53  -0.50800  1.0 3.0
   38    33    52    48  -0.28300  1.0 1.0
   38    33    52    48   0.26700 -1.0 2.0
   38    33    52    48  -0.63300  1.0 3.0
   38    33    52    53   0.09700  1.0 1.0
   38    33    52    53   0.15600 -1.0 2.0
   38    33    52    53  -0.50800  1.0 3.0
   38    39    42    43   1.00000 -1.0 2.0
   38    39    42    46  -1.18350  1.0 1.0
   38    39    42    46   1.45950 -1.0 2.0
   38    39    56    54   0.28850  1.0 1.0
   38    39    56    54   2.61350 -1.0 2.0
   38    39    56    54   0.78400  1.0 3.0
   38    39    56    57  -0.18600  1.0 3.0
   38    40    44    45   7.00000 -1.0 2.0
   38    40   -44    48   7.00000 -1.0 2.0
   39    38    40    41  -0.18600  1.0 3.0
   39    38    40    44   0.28850  1.0 1.0
   39    38    40    44   2.61350 -1.0 2.0
   39    38    40    44   0.78400  1.0 3.0
   39    42    46    47   1.50000 -1.0 2.0
   39    42    46    50  -1.18350  1.0 1.0
   39    42    46    50   1.45950 -1.0 2.0
   42    39    56    54  -0.18600  1.0 3.0
   42    39    56    57   1.08500 -1.0 2.0
   42    46    50    51   7.00000 -1.0 2.0
   42    46   -50    54   7.00000 -1.0 2.0
   43    42    46    47  -0.52200  1.0 1.0
   43    42    46    47   0.82950 -1.0 2.0
   43    42    46    50   1.00000 -1.0 2.0
   46    50    54    55  -0.18600  1.0 3.0
   46    50    54    56   0.28850  1.0 1.0
   46    50    54    56   2.61350 -1.0 2.0
   46    50    54    56   0.78400  1.0 3.0
   47    46    50    51   7.00000 -1.0 2.0
   47    46    50    54   7.00000 -1.0 2.0
   50    54   -56    39   7.00000 -1.0 2.0
   50    54    56    57   7.00000 -1.0 2.0
   51    50    54    55   0.00000  1.0 1.0
   51    50    54    56  -0.18600  1.0 3.0
   55    54    56    39   7.00000 -1.0 2.0
   55    54    56    57   7.00000 -1.0 2.0
   56    39    42    43   1.00000 -1.0 2.0
   56    39   -42    46  -1.18350  1.0 1.0
   56    39   -42    46   1.45950 -1.0 2.0
   40    38    39    42   7.00000 -1.0 2.0
   40    38    39    56   7.00000 -1.0 2.0
   40    44    48    49  -0.18600  1.0 3.0
   40    44    48    52   0.28850  1.0 1.0
   40    44    48    52   2.61350 -1.0 2.0
   40    44    48    52   0.78400  1.0 3.0
   41    40    44    45   7.00000 -1.0 2.0
   41    40    44    48   7.00000 -1.0 2.0
   44    48   -52    33   7.00000 -1.0 2.0
   44    48    52    53   7.00000 -1.0 2.0
   45    44    48    49   0.00000  1.0 1.0
   45    44    48    52  -0.18600  1.0 3.0
   49    48    52    33   7.00000 -1.0 2.0
   49    48    52    53   7.00000 -1.0 2.0
   52    33    38    39  -0.28300  1.0 1.0
   52    33    38    39   0.26700 -1.0 2.0
   52    33    38    39  -0.63300  1.0 3.0
   52    33   -38    40  -0.28300  1.0 1.0
   52    33   -38    40   0.26700 -1.0 2.0
   52    33   -38    40  -0.63300  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    40    38    39   1.10000 -1.0 2.0
   42    56    39    38   1.10000 -1.0 2.0
   39    46    42    43  10.50000 -1.0 2.0
   42    47    46    50   1.10000 -1.0 2.0
   54    51    50    46   1.10000 -1.0 2.0
   50    55    54    56   1.10000 -1.0 2.0
   39    57    56    54   1.10000 -1.0 2.0
   38    41    40    44   1.10000 -1.0 2.0
   48    45    44    40   1.10000 -1.0 2.0
   44    49    48    52   1.10000 -1.0 2.0
   33    53    52    48   1.10000 -1.0 2.0
END
